SCHEMBL9818489

SCHEMBL9818489

Nc1cc(S(=O)(=O)c2ccccc2)cc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.50
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 1/20 0.45
HSD17B10 Q99714 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CASP6 P55212 1/20 0.45
PIK3CA P42336 2/20 0.44
PIK3C3 Q8NEB9 2/20 0.44
PKM P14618 1/20 0.42
LMNA P02545 2/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
KEAP1 Q14145 1/20 0.41
HPRT1 P00492 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL342848 0.80 CASP6 (0.69) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL21822136 0.76 HTR6 (0.47) HTR6ALDH1A1KDM4EHSD17B10CYP2C19
SCHEMBL21822208 0.75 HTR6 (0.45) HTR6ALDH1A1KDM4EPIK3CAPIK3C3
SCHEMBL1332008 0.73 HTR6 (0.82) HTR6ALDH1A1HSD17B10LMNATSHR
SCHEMBL30166976 0.73 HTR6 (0.74) HTR6ALDH1A1KDM4ECYP2C9PKM
SCHEMBL950448 0.73 HTR6 (0.74) HTR6ALDH1A1KDM4ECYP2C9PKM
SCHEMBL10363195 0.72 HTR6 (0.64) HTR6ALDH1A1KDM4EHSD17B10CYP2C9
SCHEMBL10461483 0.72 HTR6 (0.58) HTR6ALDH1A1KDM4EPKMLMNA
SCHEMBL27495186 0.72 KDM4E (0.50) HTR6ALDH1A1KDM4EPIK3CAPIK3C3
SCHEMBL11682026 0.72 CYP1A2 (0.55) HTR6ALDH1A1KDM4EHSD17B10PKM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4997921-A Substituted phenylazosulfoindole dyes CIBA-GEIGY CORPORATION (US) 1991-03-05 US disclosed
US-4954563-A Polyamide dye CIBA-GEIGY CORPORATION (US) 1990-09-04 US disclosed